{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/m" } "basis-atom-coordinates" { "source-value" [ [ 0.117572 0.75 0.172606 ] [ 0.882428 0.25 0.827394 ] [ 0.304996 0.25 0.51607 ] [ 0.695004 0.75 0.48393 ] [ 0.616231 0.75 0.965781 ] [ 0.383769 0.25 0.034219 ] [ 0.805116 0.25 0.255422 ] [ 0.194884 0.75 0.744578 ] [ 0.330616 0.522705 0.829171 ] [ 0.669384 0.022705 0.170829 ] [ 0.669384 0.477295 0.170829 ] [ 0.330616 0.977295 0.829171 ] [ 0.204013 0.75 0.530227 ] [ 0.92701 0.75 0.8077 ] [ 0.795987 0.25 0.469773 ] [ 0.07299 0.25 0.1923 ] ] } "species" { "source-value" [ "Rb" "Rb" "Rb" "Rb" "Na" "Na" "Mn" "Mn" "O" "O" "O" "O" "O" "O" "O" "O" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 6.07124221362 "source-unit" "angstrom" } "b" { "source-value" 6.08634823 "source-unit" "angstrom" } "c" { "source-value" 7.97168075626 "source-unit" "angstrom" } "beta" { "source-value" 92.8320227415 "source-unit" "degree" } }